3-butyl-2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-butyl-2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-butyl-2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 3-butyl-2-[(3,3-dimethyl-2-oxobutyl)thio]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-butyl-2-(3,3-dimethyl-2-oxobutyl)sulfanylthieno[3,2-d]pyrimidin-4-one Traditional Name: 3-butyl-2-[(2-keto-3,3-dimethyl-butyl)thio]thieno[3,2-d]pyrimidin-4-one Formula: C16H22N2O2S2 MolecularWeight: 338.48808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)C(C)(C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)C(C)(C)C

InChI

InChI=1S/C16H22N2O2S2/c1-5-6-8-18-14(20)13-11(7-9-21-13)17-15(18)22-10-12(19)16(2,3)4/h7,9H,5-6,8,10H2,1-4H3